CID 87978

1,4-bis(2-methylprop-1-enyl)piperazine

Structural Information

Molecular Formula
C12H22N2
SMILES
CC(=CN1CCN(CC1)C=C(C)C)C
InChI
InChI=1S/C12H22N2/c1-11(2)9-13-5-7-14(8-6-13)10-12(3)4/h9-10H,5-8H2,1-4H3
InChIKey
YNGSZDZAESJMEY-UHFFFAOYSA-N
Compound name
1,4-bis(2-methylprop-1-enyl)piperazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

194.1783 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 195.185576 149.8
[M+Na]+ 217.167518 154.1
[M-H]- 193.171024 149.4
[M+NH4]+ 212.212123 166.6
[M+K]+ 233.141458 151.7
[M+H-H2O]+ 177.175560 142.4
[M+HCOO]- 239.176501 164.8
[M+CH3COO]- 253.192151 186.6
[M+Na-2H]- 215.152966 150.3
[M]+ 194.17775142 145.1
[M]- 194.17884858 145.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe